Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | DRD4 | P21917 | 3/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9536342 | 0.87 | ALDH1A1 (0.50) | CYP2D6GRM2KCNH2MEN1ALDH1A1 | |
| SCHEMBL9539219 | 0.85 | HRH1 (0.42) | HRH1KDM4EDRD2DRD4GRM2 | |
| Hydrochloric Acid SCHEMBL10550355 | 0.82 | KCNH2 (0.50) | HRH1CYP2D6DRD2DRD4GRM2 | |
| SCHEMBL9537584 | 0.82 | MEN1 (0.56) | HRH1KDM4EPOLBTSHRCYP2D6 | |
| Hydrochloric Acid SCHEMBL9538675 | 0.82 | KCNH2 (0.49) | HRH1CYP2D6DRD2DRD4DRD3 | |
| Bromide SCHEMBL9538473 | 0.82 | NPY1R (0.44) | KCNH2 | |
| SCHEMBL9540183 | 0.81 | ACHE (0.47) | HRH1KDM4ETSHRCYP2D6DRD2 | |
| SCHEMBL9536254 | 0.81 | MAOA (0.39) | HRH1KDM4EOPRM1OPRL1 | |
| SCHEMBL9538121 | 0.81 | KDM4E (0.42) | KDM4ETSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL9537163 | 0.80 | KDM4E (0.42) | KDM4ETSHRALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0151826-B1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-03-31 | — | — | EP | disclosed |
| US-4839374-A | TREATING ALLERGIES | JANSSEN PHARMACEUTICA, N.V. (BE) | 1989-06-13 | — | — | US | disclosed |
| US-4695575-A | ANTIHISTAMINES | JANSSEN PHARMACEUTICA, N.V. (BE) | 1987-09-22 | — | — | US | disclosed |